Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 6/20 | 0.35 |
| ▸ | CA1 | P00915 | 4/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL5476844 | 0.75 | CA2 (0.33) | CA2CA1MAPK1ALDH1A1 | |
| SCHEMBL4160464 | 0.74 | CA2 (0.35) | CA2CA1MAPK1ALDH1A1LMNA | |
| SCHEMBL4168640 | 0.74 | CA2 (0.33) | CA2CA1MAPK1 | |
| SCHEMBL186563 | 0.72 | ALDH1A1 (0.37) | CA2CA1MAPK1ALDH1A1LMNA | |
| SCHEMBL4168642 | 0.70 | CTSK (0.33) | CA2CA1MAPK1 | |
| SCHEMBL4889325 | 0.69 | CA2 (0.36) | CA2CA1MAPK1ALDH1A1LMNA | |
| SCHEMBL12918670 | 0.69 | TSHR (0.38) | MAPK1ALDH1A1 | |
| SCHEMBL15203381 | 0.69 | TSHR (0.38) | MAPK1ALDH1A1 | |
| SCHEMBL5961063 | 0.68 | CA2 (0.35) | CA2CA1MAPK1ALDH1A1 | |
| SCHEMBL15196274 | 0.68 | CA2 (0.41) | CA2CA1MAPK1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1899061-B1 | NOVEL ZIRCONIUM COMPOUND, CATALYST AND ITS USE FOR POLYURETHANE MANUFACTURE | DORF KETAL CHEMICALS INDIA PRIVATE LTD (IN) | 2014-08-13 | — | — | EP | disclosed |